UCSF

ZINC33680234

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2009 35 No

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.73 7.01 -60.03 1 10 -1 134 494.505 6
Lo Low (pH 4.5-6) 1.73 5.71 -27.78 2 10 0 131 495.513 6

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )